N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

C51H123N7Si6 — CID 175762568

IUPACN-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CN(CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N([Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C
InChIInChI=1S/C51H123N7Si6/c1-40(2)25-52(26-41(3)4)62(37-59,53(27-42(5)6)28-43(7)8)58(63(38-60,54(29-44(9)10)30-45(11)12)55(31-46(13)14)32-47(15)16)64(39-61,56(33-48(17)18)34-49(19)20)57(35-50(21)22)36-51(23)24/h40-51H,25-39H2,1-24,59-61H3
InChIKeyIOXARIOIKHHGDL-UHFFFAOYSA-N
MW1003.11 g/mol
LogP8.76
Rot. Bonds36

About N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (PubChem CID 175762568) has the molecular formula C51H123N7Si6 and a molecular weight of 1003.11 g/mol. Its IUPAC name is N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound NameN-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
PubChem CID175762568
Molecular FormulaC51H123N7Si6
Molecular Weight1003.11 g/mol
Exact Mass1001.85
IUPAC NameN-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CN(CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N([Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C
InChIInChI=1S/C51H123N7Si6/c1-40(2)25-52(26-41(3)4)62(37-59,53(27-42(5)6)28-43(7)8)58(63(38-60,54(29-44(9)10)30-45(11)12)55(31-46(13)14)32-47(15)16)64(39-61,56(33-48(17)18)34-49(19)20)57(35-50(21)22)36-51(23)24/h40-51H,25-39H2,1-24,59-61H3
InChIKeyIOXARIOIKHHGDL-UHFFFAOYSA-N
XLogP8.76
TPSA22.68 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds36
Heavy Atoms64
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001003.11
LogP ≤ 58.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (CID 175762568) is N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is CC(C)CN(CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N([Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C)[Si](C[SiH3])(N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C.
What is the InChIKey of N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The InChIKey is IOXARIOIKHHGDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H123N7Si6/c1-40(2)25-52(26-41(3)4)62(37-59,53(27-42(5)6)28-43(7)8)58(63(38-60,54(29-44(9)10)30-45(11)12)55(31-46(13)14)32-47(15)16)64(39-61,56(33-48(17)18)34-49(19)20)57(35-50(21)22)36-51(23)24/h40-51H,25-39H2,1-24,59-61H3.
What are the key properties of N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine has a molecular weight of 1003.11 g/mol, XLogP of 8.76, 36 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[bis[bis[bis(2-methylpropyl)amino]-(silylmethyl)silyl]amino]-[bis(2-methylpropyl)amino]-(silylmethyl)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 175762568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).